EFY
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C17 | C18 | sing | 1.54Å | 1.49Å | |
C17 | C16 | sing | 1.54Å | 1.51Å | |
C18 | C19 | sing | 1.54Å | 1.50Å | |
C16 | C15 | sing | 1.55Å | 1.52Å | |
C7 | C8 | doub | 1.38Å | 1.37Å | Aromatic |
C7 | C6 | sing | 1.38Å | 1.37Å | Aromatic |
C8 | C9 | sing | 1.40Å | 1.37Å | Aromatic |
C15 | C14 | sing | 1.53Å | 1.51Å | |
C15 | C19 | sing | 1.55Å | 1.52Å | |
C15 | N20 | sing | 1.47Å | 1.48Å | |
N13 | C14 | sing | 1.46Å | 1.45Å | |
N13 | C11 | sing | 1.35Å | 1.38Å | |
O22 | C21 | doub | 1.22Å | 1.22Å | |
C6 | C5 | doub | 1.38Å | 1.37Å | Aromatic |
C9 | C11 | sing | 1.48Å | 1.47Å | |
C9 | C10 | doub | 1.39Å | 1.38Å | Aromatic |
C21 | N20 | sing | 1.35Å | 1.37Å | |
C21 | C23 | sing | 1.47Å | 1.46Å | |
C11 | O12 | doub | 1.22Å | 1.22Å | |
C30 | O29 | sing | 1.34Å | 1.44Å | Aromatic |
C30 | C31 | doub | 1.37Å | 1.50Å | Aromatic |
C5 | C10 | sing | 1.38Å | 1.38Å | Aromatic |
C5 | C2 | sing | 1.51Å | 1.49Å | |
O29 | N28 | sing | 1.21Å | 1.43Å | Aromatic |
C23 | C31 | sing | 1.46Å | 1.39Å | Aromatic |
C23 | C24 | doub | 1.38Å | 1.38Å | Aromatic |
C31 | C27 | sing | 1.48Å | 1.41Å | Aromatic |
C3 | C2 | sing | 1.53Å | 1.51Å | |
C1 | C2 | sing | 1.53Å | 1.51Å | |
C2 | C4 | sing | 1.53Å | 1.51Å | |
N28 | C27 | doub | 1.31Å | 1.34Å | Aromatic |
C24 | C25 | sing | 1.39Å | 1.38Å | Aromatic |
C27 | C26 | sing | 1.41Å | 1.37Å | Aromatic |
C25 | C26 | doub | 1.36Å | 1.38Å | Aromatic |
C7 | H1 | sing | 1.08Å | 1.08Å | |
C25 | H2 | sing | 1.08Å | 1.08Å | |
C8 | H3 | sing | 1.08Å | 1.08Å | |
C24 | H4 | sing | 1.08Å | 1.08Å | |
C6 | H5 | sing | 1.08Å | 1.08Å | |
C26 | H6 | sing | 1.08Å | 1.08Å | |
C10 | H7 | sing | 1.08Å | 1.08Å | |
C30 | H8 | sing | 1.08Å | 1.08Å | |
C17 | H9 | sing | 1.09Å | 1.10Å | |
C17 | H10 | sing | 1.09Å | 1.10Å | |
C18 | H11 | sing | 1.09Å | 1.10Å | |
C18 | H12 | sing | 1.09Å | 1.10Å | |
C16 | H13 | sing | 1.09Å | 1.10Å | |
C16 | H14 | sing | 1.09Å | 1.10Å | |
C19 | H15 | sing | 1.09Å | 1.10Å | |
C19 | H16 | sing | 1.09Å | 1.10Å | |
C1 | H17 | sing | 1.09Å | 1.10Å | |
C1 | H18 | sing | 1.09Å | 1.10Å | |
C1 | H19 | sing | 1.09Å | 1.10Å | |
C3 | H20 | sing | 1.09Å | 1.10Å | |
C3 | H21 | sing | 1.09Å | 1.10Å | |
C3 | H22 | sing | 1.09Å | 1.10Å | |
C4 | H23 | sing | 1.09Å | 1.10Å | |
C4 | H24 | sing | 1.09Å | 1.10Å | |
C4 | H25 | sing | 1.09Å | 1.10Å | |
C14 | H26 | sing | 1.09Å | 1.10Å | |
C14 | H27 | sing | 1.09Å | 1.10Å | |
N20 | H28 | sing | 0.97Å | 1.00Å | |
N13 | H29 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C18 | C17 | C16 | 107.6° | 106.6° |
C17 | C18 | C19 | 106.6° | 106.6° |
C18 | C17 | H9 | 109.9° | 110.0° |
C18 | C17 | H10 | 109.9° | 110.0° |
C17 | C18 | H11 | 110.2° | 110.1° |
C17 | C18 | H12 | 110.2° | 110.1° |
C17 | C16 | C15 | 106.1° | 104.2° |
C16 | C17 | H9 | 109.9° | 110.1° |
C16 | C17 | H10 | 110.0° | 110.1° |
C17 | C16 | H13 | 110.3° | 110.5° |
C17 | C16 | H14 | 110.3° | 110.5° |
C18 | C19 | C15 | 105.1° | 104.2° |
C19 | C18 | H11 | 110.2° | 110.0° |
C19 | C18 | H12 | 110.2° | 110.0° |
C18 | C19 | H15 | 110.5° | 110.6° |
C18 | C19 | H16 | 110.5° | 110.5° |
C16 | C15 | C14 | 112.3° | 110.8° |
C16 | C15 | C19 | 103.5° | 102.7° |
C16 | C15 | N20 | 110.1° | 110.7° |
C15 | C16 | H13 | 110.3° | 110.5° |
C15 | C16 | H14 | 110.3° | 110.5° |
C8 | C7 | C6 | 120.1° | 120.1° |
C7 | C8 | C9 | 119.0° | 119.9° |
C8 | C7 | H1 | 120.0° | 119.9° |
C7 | C8 | H3 | 120.5° | 120.1° |
C7 | C6 | C5 | 120.9° | 120.3° |
C6 | C7 | H1 | 120.0° | 120.0° |
C7 | C6 | H5 | 119.6° | 119.8° |
C8 | C9 | C11 | 118.7° | 120.1° |
C8 | C9 | C10 | 121.4° | 119.7° |
C9 | C8 | H3 | 120.5° | 120.1° |
C14 | C15 | C19 | 113.8° | 110.8° |
C14 | C15 | N20 | 108.1° | 110.7° |
C15 | C14 | N13 | 113.3° | 109.4° |
C15 | C14 | H26 | 108.5° | 109.4° |
C15 | C14 | H27 | 108.5° | 109.5° |
C19 | C15 | N20 | 108.9° | 110.9° |
C15 | C19 | H15 | 110.5° | 110.5° |
C15 | C19 | H16 | 110.6° | 110.6° |
C15 | N20 | C21 | 118.3° | 120.0° |
C15 | N20 | H28 | 120.9° | 120.0° |
C14 | N13 | C11 | 122.2° | 120.0° |
N13 | C14 | H26 | 108.5° | 109.5° |
N13 | C14 | H27 | 108.5° | 109.4° |
C14 | N13 | H29 | 118.9° | 120.0° |
N13 | C11 | C9 | 114.0° | 120.0° |
N13 | C11 | O12 | 126.7° | 120.0° |
C11 | N13 | H29 | 118.9° | 120.0° |
O22 | C21 | N20 | 123.5° | 120.0° |
O22 | C21 | C23 | 120.9° | 120.0° |
C6 | C5 | C10 | 119.4° | 120.1° |
C6 | C5 | C2 | 118.9° | 119.9° |
C5 | C6 | H5 | 119.6° | 119.9° |
C11 | C9 | C10 | 119.9° | 120.2° |
C9 | C11 | O12 | 119.2° | 120.0° |
C9 | C10 | C5 | 119.3° | 119.9° |
C9 | C10 | H7 | 120.4° | 120.1° |
N20 | C21 | C23 | 115.5° | 120.0° |
C21 | N20 | H28 | 120.9° | 120.0° |
C21 | C23 | C31 | 119.6° | 120.8° |
C21 | C23 | C24 | 122.0° | 120.8° |
O29 | C30 | C31 | 104.9° | 106.1° |
C30 | O29 | N28 | 107.3° | 113.6° |
O29 | C30 | H8 | 127.5° | 126.9° |
C30 | C31 | C23 | 133.1° | 138.0° |
C30 | C31 | C27 | 107.3° | 103.4° |
C31 | C30 | H8 | 127.5° | 127.0° |
C10 | C5 | C2 | 121.7° | 120.0° |
C5 | C10 | H7 | 120.3° | 120.0° |
C5 | C2 | C3 | 108.9° | 109.5° |
C5 | C2 | C1 | 109.0° | 109.5° |
C5 | C2 | C4 | 109.6° | 109.5° |
O29 | N28 | C27 | 110.8° | 112.0° |
C31 | C23 | C24 | 118.4° | 118.4° |
C23 | C31 | C27 | 119.5° | 118.6° |
C23 | C24 | C25 | 121.7° | 121.3° |
C23 | C24 | H4 | 119.1° | 119.3° |
C31 | C27 | N28 | 109.6° | 104.9° |
C31 | C27 | C26 | 121.1° | 118.4° |
C3 | C2 | C1 | 109.3° | 109.4° |
C3 | C2 | C4 | 109.7° | 109.5° |
C2 | C3 | H20 | 109.5° | 109.5° |
C2 | C3 | H21 | 109.5° | 109.5° |
C2 | C3 | H22 | 109.5° | 109.5° |
C1 | C2 | C4 | 110.3° | 109.5° |
C2 | C1 | H17 | 109.5° | 109.5° |
C2 | C1 | H18 | 109.5° | 109.5° |
C2 | C1 | H19 | 109.4° | 109.4° |
C2 | C4 | H23 | 109.5° | 109.5° |
C2 | C4 | H24 | 109.5° | 109.5° |
C2 | C4 | H25 | 109.5° | 109.5° |
N28 | C27 | C26 | 129.3° | 136.7° |
C24 | C25 | C26 | 120.4° | 122.9° |
C24 | C25 | H2 | 119.8° | 118.6° |
C25 | C24 | H4 | 119.1° | 119.4° |
C27 | C26 | C25 | 118.9° | 120.4° |
C27 | C26 | H6 | 120.5° | 119.8° |
C26 | C25 | H2 | 119.8° | 118.5° |
C25 | C26 | H6 | 120.5° | 119.8° |
H9 | C17 | H10 | 109.5° | 110.0° |
H11 | C18 | H12 | 109.5° | 110.0° |
H13 | C16 | H14 | 109.5° | 110.6° |
H15 | C19 | H16 | 109.5° | 110.4° |
H17 | C1 | H18 | 109.5° | 109.5° |
H17 | C1 | H19 | 109.5° | 109.5° |
H18 | C1 | H19 | 109.5° | 109.5° |
H20 | C3 | H21 | 109.4° | 109.4° |
H20 | C3 | H22 | 109.4° | 109.5° |
H21 | C3 | H22 | 109.5° | 109.5° |
H23 | C4 | H24 | 109.5° | 109.5° |
H23 | C4 | H25 | 109.5° | 109.5° |
H24 | C4 | H25 | 109.5° | 109.5° |
H26 | C14 | H27 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C18 | C17 | C16 | H9 | 119.7° | 119.3° |
C18 | C17 | C16 | H10 | 119.7° | 119.3° |
C17 | C18 | C19 | H11 | 119.6° | 119.3° |
C17 | C18 | C19 | H12 | 119.5° | 119.3° |
C18 | C17 | C16 | C15 | 11.9° | 23.6° |
C17 | C18 | C19 | C15 | 27.0° | 23.6° |
C18 | C17 | H9 | H10 | 120.9° | 121.4° |
C17 | C18 | H11 | H12 | 121.3° | 121.4° |
C18 | C17 | C16 | H13 | 131.3° | 95.0° |
C18 | C17 | C16 | H14 | 107.6° | 142.2° |
C17 | C18 | C19 | H15 | 92.3° | 142.3° |
C17 | C18 | C19 | H16 | 146.3° | 95.2° |
C16 | C17 | C18 | C19 | 9.3° | 0.0° |
C17 | C16 | C15 | H13 | 119.5° | 118.7° |
C17 | C16 | C15 | H14 | 119.5° | 118.6° |
C17 | C16 | C15 | C14 | 95.2° | 156.3° |
C17 | C16 | C15 | C19 | 28.0° | 37.9° |
C17 | C16 | C15 | N20 | 144.2° | 80.5° |
C16 | C17 | H9 | H10 | 120.9° | 121.4° |
C16 | C17 | C18 | H11 | 128.9° | 119.3° |
C16 | C17 | C18 | H12 | 110.2° | 119.3° |
C17 | C16 | H13 | H14 | 121.6° | 122.6° |
C18 | C19 | C15 | C16 | 33.8° | 37.9° |
C18 | C19 | C15 | C14 | 88.4° | 156.2° |
C18 | C19 | C15 | H15 | 119.3° | 118.8° |
C18 | C19 | C15 | H16 | 119.3° | 118.7° |
C18 | C19 | C15 | N20 | 150.9° | 80.5° |
C19 | C18 | C17 | H9 | 129.0° | 119.3° |
C19 | C18 | C17 | H10 | 110.4° | 119.3° |
C19 | C18 | H11 | H12 | 121.3° | 121.4° |
C18 | C19 | H15 | H16 | 122.0° | 122.6° |
C16 | C15 | C14 | C19 | 117.2° | 113.3° |
C16 | C15 | C14 | N20 | 121.7° | 123.2° |
C16 | C15 | C19 | N20 | 117.1° | 118.3° |
C16 | C15 | C14 | N13 | 63.3° | 179.8° |
C16 | C15 | N20 | C21 | 36.6° | 59.7° |
C15 | C16 | C17 | H9 | 107.8° | 142.9° |
C15 | C16 | C17 | H10 | 131.6° | 95.7° |
C15 | C16 | H13 | H14 | 121.6° | 122.6° |
C16 | C15 | C19 | H15 | 85.6° | 156.7° |
C16 | C15 | C19 | H16 | 153.1° | 80.8° |
C16 | C15 | C14 | H26 | 176.1° | 59.8° |
C16 | C15 | C14 | H27 | 57.2° | 60.3° |
C16 | C15 | N20 | H28 | 143.4° | 120.3° |
C8 | C7 | C6 | H1 | 180.0° | 179.7° |
C7 | C8 | C9 | H3 | 180.0° | 179.9° |
C8 | C7 | C6 | C5 | 0.1° | 0.0° |
C7 | C8 | C9 | C11 | 179.9° | 180.0° |
C7 | C8 | C9 | C10 | 0.0° | 0.1° |
C8 | C7 | C6 | H5 | 179.9° | 180.0° |
C6 | C7 | C8 | C9 | 0.0° | 0.0° |
C7 | C6 | C5 | H5 | 180.0° | 180.0° |
C7 | C6 | C5 | C10 | 0.2° | 0.0° |
C7 | C6 | C5 | C2 | 179.9° | 179.9° |
C6 | C7 | C8 | H3 | 180.0° | 180.0° |
C8 | C9 | C11 | N13 | 22.4° | 0.1° |
C8 | C9 | C11 | C10 | 179.9° | 179.9° |
C8 | C9 | C11 | O12 | 157.5° | 180.0° |
C8 | C9 | C10 | C5 | 0.1° | 0.0° |
C9 | C8 | C7 | H1 | 180.0° | 179.7° |
C8 | C9 | C10 | H7 | 179.9° | 180.0° |
C14 | C15 | C19 | N20 | 120.7° | 123.3° |
C15 | C14 | N13 | H26 | 120.6° | 120.0° |
C15 | C14 | N13 | H27 | 120.5° | 120.0° |
C15 | C14 | N13 | C11 | 89.1° | 175.0° |
C14 | C15 | N20 | C21 | 159.7° | 63.6° |
C14 | C15 | C16 | H13 | 24.3° | 37.6° |
C14 | C15 | C16 | H14 | 145.3° | 85.1° |
C14 | C15 | C19 | H15 | 152.3° | 85.0° |
C14 | C15 | C19 | H16 | 30.9° | 37.5° |
C15 | C14 | H26 | H27 | 118.3° | 120.0° |
C14 | C15 | N20 | H28 | 20.3° | 116.5° |
C15 | C14 | N13 | H29 | 90.9° | 4.9° |
C19 | C15 | C14 | N13 | 179.5° | 66.4° |
C19 | C15 | N20 | C21 | 76.2° | 173.1° |
C15 | C19 | C18 | H11 | 146.5° | 95.7° |
C15 | C19 | C18 | H12 | 92.6° | 142.9° |
C19 | C15 | C16 | H13 | 147.5° | 80.8° |
C19 | C15 | C16 | H14 | 91.5° | 156.5° |
C15 | C19 | H15 | H16 | 122.0° | 122.6° |
C19 | C15 | C14 | H26 | 59.0° | 53.5° |
C19 | C15 | C14 | H27 | 59.9° | 173.6° |
C19 | C15 | N20 | H28 | 103.8° | 6.9° |
N20 | C15 | C14 | N13 | 58.4° | 57.0° |
C15 | N20 | C21 | O22 | 12.9° | 4.7° |
C15 | N20 | C21 | H28 | 180.0° | 180.0° |
C15 | N20 | C21 | C23 | 163.3° | 175.3° |
N20 | C15 | C16 | H13 | 96.3° | 160.8° |
N20 | C15 | C16 | H14 | 24.7° | 38.1° |
N20 | C15 | C19 | H15 | 31.6° | 38.3° |
N20 | C15 | C19 | H16 | 89.8° | 160.8° |
N20 | C15 | C14 | H26 | 62.1° | 177.0° |
N20 | C15 | C14 | H27 | 179.0° | 63.0° |
C14 | N13 | C11 | H29 | 180.0° | 179.9° |
C14 | N13 | C11 | C9 | 167.2° | 180.0° |
C14 | N13 | C11 | O12 | 12.6° | 0.0° |
N13 | C14 | H26 | H27 | 118.2° | 120.0° |
N13 | C11 | C9 | O12 | 179.9° | 179.9° |
N13 | C11 | C9 | C10 | 157.8° | 180.0° |
C11 | N13 | C14 | H26 | 31.5° | 55.1° |
C11 | N13 | C14 | H27 | 150.4° | 65.0° |
O22 | C21 | N20 | C23 | 176.3° | 180.0° |
O22 | C21 | C23 | C31 | 2.5° | 0.0° |
O22 | C21 | C23 | C24 | 178.6° | 179.8° |
O22 | C21 | N20 | H28 | 167.1° | 175.3° |
C6 | C5 | C10 | C9 | 0.3° | 0.0° |
C6 | C5 | C10 | C2 | 179.7° | 180.0° |
C6 | C5 | C2 | C3 | 13.7° | 120.0° |
C6 | C5 | C2 | C1 | 105.4° | 0.0° |
C6 | C5 | C2 | C4 | 133.7° | 120.0° |
C5 | C6 | C7 | H1 | 179.9° | 179.7° |
C6 | C5 | C10 | H7 | 179.8° | 179.9° |
C11 | C9 | C10 | C5 | 180.0° | 180.0° |
C11 | C9 | C8 | H3 | 0.1° | 0.1° |
C11 | C9 | C10 | H7 | 0.0° | 0.1° |
C9 | C11 | N13 | H29 | 12.8° | 0.0° |
C10 | C9 | C11 | O12 | 22.3° | 0.1° |
C9 | C10 | C5 | H7 | 180.0° | 180.0° |
C9 | C10 | C5 | C2 | 179.9° | 180.0° |
C10 | C9 | C8 | H3 | 180.0° | 180.0° |
N20 | C21 | C23 | C31 | 178.8° | 180.0° |
N20 | C21 | C23 | C24 | 2.2° | 0.2° |
C21 | C23 | C31 | C30 | 1.1° | 0.0° |
C21 | C23 | C31 | C24 | 179.0° | 179.8° |
C21 | C23 | C31 | C27 | 179.6° | 179.9° |
C21 | C23 | C24 | C25 | 179.8° | 179.8° |
C21 | C23 | C24 | H4 | 0.2° | 0.2° |
C23 | C21 | N20 | H28 | 16.7° | 4.6° |
O12 | C11 | N13 | H29 | 167.4° | 179.9° |
O29 | C30 | C31 | H8 | 180.0° | 180.0° |
O29 | C30 | C31 | C23 | 179.6° | 180.0° |
O29 | C30 | C31 | C27 | 0.2° | 0.0° |
C30 | O29 | N28 | C27 | 0.0° | 0.0° |
C31 | C30 | O29 | N28 | 0.1° | 0.1° |
C30 | C31 | C23 | C27 | 179.3° | 179.9° |
C30 | C31 | C23 | C24 | 179.9° | 179.8° |
C30 | C31 | C27 | N28 | 0.3° | 0.0° |
C30 | C31 | C27 | C26 | 179.6° | 179.6° |
C10 | C5 | C2 | C3 | 166.0° | 60.0° |
C10 | C5 | C2 | C1 | 74.9° | 180.0° |
C10 | C5 | C2 | C4 | 45.9° | 60.0° |
C10 | C5 | C6 | H5 | 179.8° | 180.0° |
C5 | C2 | C3 | C1 | 119.0° | 120.0° |
C5 | C2 | C3 | C4 | 120.0° | 120.0° |
C5 | C2 | C1 | C4 | 120.4° | 120.0° |
C2 | C5 | C6 | H5 | 0.1° | 0.0° |
C2 | C5 | C10 | H7 | 0.1° | 0.1° |
C5 | C2 | C1 | H17 | 180.0° | 60.0° |
C5 | C2 | C1 | H18 | 60.0° | 180.0° |
C5 | C2 | C1 | H19 | 60.0° | 60.0° |
C5 | C2 | C3 | H20 | 180.0° | 60.0° |
C5 | C2 | C3 | H21 | 60.0° | 180.0° |
C5 | C2 | C3 | H22 | 60.0° | 60.0° |
C5 | C2 | C4 | H23 | 180.0° | 60.0° |
C5 | C2 | C4 | H24 | 60.0° | 180.0° |
C5 | C2 | C4 | H25 | 60.0° | 60.0° |
O29 | N28 | C27 | C31 | 0.2° | 0.0° |
O29 | N28 | C27 | C26 | 179.7° | 179.4° |
N28 | O29 | C30 | H8 | 179.8° | 180.0° |
C23 | C31 | C27 | N28 | 179.7° | 180.0° |
C31 | C23 | C24 | C25 | 0.8° | 0.1° |
C23 | C31 | C27 | C26 | 0.2° | 0.5° |
C31 | C23 | C24 | H4 | 179.2° | 180.0° |
C23 | C31 | C30 | H8 | 0.4° | 0.0° |
C24 | C23 | C31 | C27 | 0.6° | 0.2° |
C23 | C24 | C25 | H4 | 180.0° | 179.9° |
C23 | C24 | C25 | C26 | 0.5° | 0.1° |
C23 | C24 | C25 | H2 | 179.5° | 179.7° |
C31 | C27 | N28 | C26 | 179.9° | 179.4° |
C31 | C27 | C26 | C25 | 0.2° | 0.4° |
C31 | C27 | C26 | H6 | 179.9° | 179.5° |
C27 | C31 | C30 | H8 | 179.7° | 180.0° |
C3 | C2 | C1 | C4 | 120.7° | 120.0° |
C3 | C2 | C1 | H17 | 61.1° | 60.0° |
C3 | C2 | C1 | H18 | 58.9° | 60.0° |
C3 | C2 | C1 | H19 | 178.9° | 180.0° |
C2 | C3 | H20 | H21 | 120.0° | 120.0° |
C2 | C3 | H20 | H22 | 120.0° | 120.0° |
C2 | C3 | H21 | H22 | 120.0° | 120.0° |
C3 | C2 | C4 | H23 | 60.5° | 180.0° |
C3 | C2 | C4 | H24 | 179.5° | 60.0° |
C3 | C2 | C4 | H25 | 59.5° | 60.0° |
C2 | C1 | H17 | H18 | 120.0° | 120.0° |
C2 | C1 | H17 | H19 | 120.0° | 120.0° |
C2 | C1 | H18 | H19 | 120.0° | 120.0° |
C1 | C2 | C3 | H20 | 61.0° | 180.0° |
C1 | C2 | C3 | H21 | 179.0° | 60.0° |
C1 | C2 | C3 | H22 | 58.9° | 60.0° |
C1 | C2 | C4 | H23 | 60.0° | 60.1° |
C1 | C2 | C4 | H24 | 60.1° | 60.0° |
C1 | C2 | C4 | H25 | 179.9° | 180.0° |
C4 | C2 | C1 | H17 | 59.6° | 180.0° |
C4 | C2 | C1 | H18 | 179.6° | 60.0° |
C4 | C2 | C1 | H19 | 60.5° | 60.0° |
C4 | C2 | C3 | H20 | 60.0° | 60.0° |
C4 | C2 | C3 | H21 | 60.0° | 60.0° |
C4 | C2 | C3 | H22 | 180.0° | 180.0° |
C2 | C4 | H23 | H24 | 120.0° | 120.0° |
C2 | C4 | H23 | H25 | 120.0° | 120.0° |
C2 | C4 | H24 | H25 | 120.0° | 120.0° |
N28 | C27 | C26 | C25 | 180.0° | 179.8° |
N28 | C27 | C26 | H6 | 0.0° | 0.1° |
C24 | C25 | C26 | C27 | 0.0° | 0.1° |
C24 | C25 | C26 | H2 | 180.0° | 179.8° |
C24 | C25 | C26 | H6 | 180.0° | 179.8° |
C27 | C26 | C25 | H6 | 180.0° | 179.9° |
C27 | C26 | C25 | H2 | 180.0° | 180.0° |
C26 | C25 | C24 | H4 | 179.5° | 180.0° |
H1 | C7 | C8 | H3 | 0.0° | 0.3° |
H1 | C7 | C6 | H5 | 0.1° | 0.3° |
H2 | C25 | C24 | H4 | 0.5° | 0.2° |
H2 | C25 | C26 | H6 | 0.1° | 0.1° |
H9 | C17 | C18 | H11 | 111.4° | 121.4° |
H9 | C17 | C18 | H12 | 9.5° | 0.0° |
H9 | C17 | C16 | H13 | 11.6° | 24.3° |
H9 | C17 | C16 | H14 | 132.7° | 98.4° |
H10 | C17 | C18 | H11 | 9.2° | 0.0° |
H10 | C17 | C18 | H12 | 130.1° | 121.4° |
H10 | C17 | C16 | H13 | 108.9° | 145.7° |
H10 | C17 | C16 | H14 | 12.1° | 23.0° |
H11 | C18 | C19 | H15 | 27.2° | 23.0° |
H11 | C18 | C19 | H16 | 94.2° | 145.5° |
H12 | C18 | C19 | H15 | 148.1° | 98.4° |
H12 | C18 | C19 | H16 | 26.8° | 24.1° |
H17 | C1 | H18 | H19 | 120.0° | 120.0° |
H20 | C3 | H21 | H22 | 120.0° | 120.0° |
H23 | C4 | H24 | H25 | 120.0° | 120.0° |
H26 | C14 | N13 | H29 | 148.5° | 124.8° |
H27 | C14 | N13 | H29 | 29.6° | 115.1° |